CID 1118

Sulfuric acid

Structural Information

Molecular Formula
H2O4S
SMILES
OS(=O)(=O)O
InChI
InChI=1S/H2O4S/c1-5(2,3)4/h(H2,1,2,3,4)
InChIKey
QAOWNCQODCNURD-UHFFFAOYSA-N
Compound name
sulfuric acid
Related CIDs

2D Structure

compound 2d structure
11
Annotation Hits

31909
References

970446
Patents

97.96738 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 98.974656 111.1
[M+Na]+ 120.95660 120.5
[M-H]- 96.960104 109.7
[M+NH4]+ 116.00120 133.4
[M+K]+ 136.93054 119.6
[M+H-H2O]+ 80.964640 107.9
[M+HCOO]- 142.96558 128.0
[M+CH3COO]- 156.98123 154.2
[M+Na-2H]- 118.94205 117.3
[M]+ 97.966831 112.2
[M]- 97.967929 112.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.